2-azanyl-1-(2-bromophenyl)-4-[2,4-dimethyl-5-[(4-methylphenoxy)methyl]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile

Systemtic Name: 2-azanyl-1-(2-bromophenyl)-4-[2,4-dimethyl-5-[(4-methylphenoxy)methyl]phenyl]-5-oxidanylidene-4,6,7,8-tetrahydroquinoline-3-carbonitrile Openeye Name: 2-amino-1-(2-bromophenyl)-4-[2,4-dimethyl-5-[(4-methylphenoxy)methyl]phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile CAS Name: 2-amino-1-(2-bromophenyl)-4-[2,4-dimethyl-5-[(4-methylphenoxy)methyl]phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile IUPAC Name: 2-amino-1-(2-bromophenyl)-4-[2,4-dimethyl-5-[(4-methylphenoxy)methyl]phenyl]-5-oxo-4,6,7,8-tetrahydroquinoline-3-carbonitrile Traditional Name: 2-amino-1-(2-bromophenyl)-4-[2,4-dimethyl-5-[(4-methylphenoxy)methyl]phenyl]-5-keto-4,6,7,8-tetrahydroquinoline-3-carbonitrile Formula: C32H30BrN3O2 MolecularWeight: 568.5035

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=C(C=C(C(=C2)C3C(=C(N(C4=C3C(=O)CCC4)C5=CC=CC=C5Br)N)C#N)C)C

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=C(C=C(C(=C2)C3C(=C(N(C4=C3C(=O)CCC4)C5=CC=CC=C5Br)N)C#N)C)C

InChI

InChI=1S/C32H30BrN3O2/c1-19-11-13-23(14-12-19)38-18-22-16-24(21(3)15-20(22)2)30-25(17-34)32(35)36(27-8-5-4-7-26(27)33)28-9-6-10-29(37)31(28)30/h4-5,7-8,11-16,30H,6,9-10,18,35H2,1-3H3